Vitas-M small molecule compound
diethyl 2-[7-methoxy-2,2-dimethyl-1-(phenylcarbonyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK077101
SMILES CCOC(=O)C1=C(S/C(=C\2/c3ccc(cc3N(C(C2=S)(C)C)C(=O)c2ccccc2)OC)/S1)C(=O)OCC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H27NO6S3 MW 569.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6S3/c1-6-34-25(31)21-22(26(32)35-7-2)38-27(37-21)20-18-14-13-17(33-5)15-19(18)29(28(3,4)23(20)36)24(30)16-11-9-8-10-12-16/h8-15H,6-7H2,1-5H3InChIKey
YGOHJRXBNIRHON-UHFFFAOYSA-NSynonyms
332019-12-2332019122
CCOC(=O)C1=C(SC(=C2C3=C(C=C(C=C3)OC)N(C(C2=S)(C)C)C(=O)C4=CC=CC=C4)S1)C(=O)OCC
CCOC(=O)C1=C(SC(=C2c3ccc(cc3N(C(C2=S)(C)C)C(=O)c2ccccc2)OC)S1)C(=O)OCC
DIETHYL2(1BENZOYL7METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(1BENZOYL7METHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(1benzoyl7methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIETHYL2(7METHOXY22DIMETHYL1(PHENYLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC28H27NO6S3c163425(31)2122(26(32)3572)3827(3721)2018141317(335)1519(18)29(28(34)23(20)36)24(30)161198101216h815H67H215H3
MFCD01171296
STK077101
ZINC000006545831
ZINC06545831
ZINC6545831
Check stock
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Check stock on Vitas-MAvailable files
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